2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide

C10H21N3O — CID 63759548

IUPAC2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCCC1CN
InChIInChI=1S/C10H21N3O/c1-8(2)12-10(14)7-13-5-3-4-9(13)6-11/h8-9H,3-7,11H2,1-2H3,(H,12,14)
InChIKeyUPPIWFZAIPRWBJ-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.07
Rot. Bonds4

About 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide

2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide (PubChem CID 63759548) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
PubChem CID63759548
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC Name2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN1CCCC1CN
InChIInChI=1S/C10H21N3O/c1-8(2)12-10(14)7-13-5-3-4-9(13)6-11/h8-9H,3-7,11H2,1-2H3,(H,12,14)
InChIKeyUPPIWFZAIPRWBJ-UHFFFAOYSA-N
XLogP-0.07
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(propan-2-ylcarbamoyl)acetamide
CID 81492867
3-[2-(aminomethyl)azepan-1-yl]-N-propan-2-ylpropanamide
CID 116640520
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-cyclopentylacetamide
CID 63760691
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119926962
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(cyanomethyl)acetamide
CID 115312682
2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide
CID 59945974
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-cyclohexylacetamide;hydrochloride
CID 119926969
N-butan-2-yl-2-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 62733673
2-[2-[(2-methylpropylamino)methyl]piperidin-1-yl]-N-propan-2-ylacetamide
CID 63855304
2-[2-(aminomethyl)pyrrolidin-1-yl]-N,N-di(propan-2-yl)acetamide;hydrochloride
CID 119926999
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(cyclopropylcarbamoyl)acetamide
CID 81492966
2-[2-(2-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 63760086

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide (CID 63759548) is 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide is CC(C)NC(=O)CN1CCCC1CN.
What is the InChIKey of 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
The InChIKey is UPPIWFZAIPRWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-8(2)12-10(14)7-13-5-3-4-9(13)6-11/h8-9H,3-7,11H2,1-2H3,(H,12,14).
What are the key properties of 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide?
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide has a molecular weight of 199.30 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)pyrrolidin-1-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 63759548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).